# generated using pymatgen data_TbNdFe14B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.75199100 _cell_length_b 8.75199100 _cell_length_c 12.06694600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbNdFe14B _chemical_formula_sum 'Tb4 Nd4 Fe56 B4' _cell_volume 924.29604353 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Tb Tb0 1 0.64394800 0.64394800 0.50000000 1.0 Tb Tb1 1 0.35605200 0.35605200 0.50000000 1.0 Tb Tb2 1 0.85605200 0.14394800 0.00000000 1.0 Tb Tb3 1 0.14394800 0.85605200 0.00000000 1.0 Nd Nd4 1 0.23359700 0.76640300 0.50000000 1.0 Nd Nd5 1 0.76640300 0.23359700 0.50000000 1.0 Nd Nd6 1 0.26640300 0.26640300 0.00000000 1.0 Nd Nd7 1 0.73359700 0.73359700 0.00000000 1.0 Fe Fe8 1 0.18246500 0.81753500 0.25319400 1.0 Fe Fe9 1 0.81753500 0.18246500 0.25319400 1.0 Fe Fe10 1 0.31753500 0.31753500 0.75319400 1.0 Fe Fe11 1 0.68246500 0.68246500 0.75319400 1.0 Fe Fe12 1 0.81753500 0.18246500 0.74680600 1.0 Fe Fe13 1 0.18246500 0.81753500 0.74680600 1.0 Fe Fe14 1 0.68246500 0.68246500 0.24680600 1.0 Fe Fe15 1 0.31753500 0.31753500 0.24680600 1.0 Fe Fe16 1 0.40299000 0.59701000 0.29711800 1.0 Fe Fe17 1 0.59701000 0.40299000 0.29711800 1.0 Fe Fe18 1 0.09701000 0.09701000 0.79711800 1.0 Fe Fe19 1 0.90299000 0.90299000 0.79711800 1.0 Fe Fe20 1 0.59701000 0.40299000 0.70288200 1.0 Fe Fe21 1 0.40299000 0.59701000 0.70288200 1.0 Fe Fe22 1 0.90299000 0.90299000 0.20288200 1.0 Fe Fe23 1 0.09701000 0.09701000 0.20288200 1.0 Fe Fe24 1 0.14041900 0.53629300 0.32398800 1.0 Fe Fe25 1 0.85958100 0.46370700 0.32398800 1.0 Fe Fe26 1 0.35958100 0.03629300 0.82398800 1.0 Fe Fe27 1 0.64041900 0.96370700 0.82398800 1.0 Fe Fe28 1 0.85958100 0.46370700 0.67601200 1.0 Fe Fe29 1 0.14041900 0.53629300 0.67601200 1.0 Fe Fe30 1 0.64041900 0.96370700 0.17601200 1.0 Fe Fe31 1 0.35958100 0.03629300 0.17601200 1.0 Fe Fe32 1 0.53629300 0.14041900 0.32398800 1.0 Fe Fe33 1 0.46370700 0.85958100 0.32398800 1.0 Fe Fe34 1 0.03629300 0.35958100 0.82398800 1.0 Fe Fe35 1 0.96370700 0.64041900 0.82398800 1.0 Fe Fe36 1 0.46370700 0.85958100 0.67601200 1.0 Fe Fe37 1 0.53629300 0.14041900 0.67601200 1.0 Fe Fe38 1 0.96370700 0.64041900 0.17601200 1.0 Fe Fe39 1 0.03629300 0.35958100 0.17601200 1.0 Fe Fe40 1 0.50000000 0.50000000 0.11431300 1.0 Fe Fe41 1 0.00000000 0.00000000 0.61431300 1.0 Fe Fe42 1 0.50000000 0.50000000 0.88568700 1.0 Fe Fe43 1 0.00000000 0.00000000 0.38568700 1.0 Fe Fe44 1 0.93207800 0.72428000 0.37286100 1.0 Fe Fe45 1 0.06792200 0.27572000 0.37286100 1.0 Fe Fe46 1 0.56792200 0.22428000 0.87286100 1.0 Fe Fe47 1 0.43207800 0.77572000 0.87286100 1.0 Fe Fe48 1 0.06792200 0.27572000 0.62713900 1.0 Fe Fe49 1 0.93207800 0.72428000 0.62713900 1.0 Fe Fe50 1 0.43207800 0.77572000 0.12713900 1.0 Fe Fe51 1 0.56792200 0.22428000 0.12713900 1.0 Fe Fe52 1 0.72428000 0.93207800 0.37286100 1.0 Fe Fe53 1 0.27572000 0.06792200 0.37286100 1.0 Fe Fe54 1 0.22428000 0.56792200 0.87286100 1.0 Fe Fe55 1 0.77572000 0.43207800 0.87286100 1.0 Fe Fe56 1 0.27572000 0.06792200 0.62713900 1.0 Fe Fe57 1 0.72428000 0.93207800 0.62713900 1.0 Fe Fe58 1 0.77572000 0.43207800 0.12713900 1.0 Fe Fe59 1 0.22428000 0.56792200 0.12713900 1.0 Fe Fe60 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe61 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe62 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe63 1 0.00000000 0.50000000 0.00000000 1.0 B B64 1 0.87400600 0.87400600 0.50000000 1.0 B B65 1 0.12599400 0.12599400 0.50000000 1.0 B B66 1 0.62599400 0.37400600 0.00000000 1.0 B B67 1 0.37400600 0.62599400 0.00000000 1.0